Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate
TL;DR: Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate (CAS 102322-85-0) is a chemical compound with molecular formula C14H24O and molecular weight 208.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-1,2,4,4-tetramethyl-3-prop-1-en-2-yloxybicyclo[3.1.1]heptane
Also Known As: Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate, Bicyclo[3.1.1]heptanol, 2,6,6-trimethyl-, acetate, (3S,4S)-2,2,4,5-tetramethyl-3-prop-1-en-2-yloxybicyclo[3.1.1]heptane, RefChem:119716
| Molecular Formula | C14H24O |
|---|---|
| Molecular Weight | 208.18 g/mol |
| LogP | 3.9974 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.18271 |
| Heavy Atoms | 15 |
| Complexity | 283.71384 |
Chemical Identifiers
| CAS Number | 102322-85-0 |
|---|---|
| SMILES | C[C@@H]1[C@@H](C(C2CC1(C2)C)(C)C)OC(=C)C |
Product Overview
Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate (CAS 102322-85-0), with molecular formula C14H24O and molecular weight 208.18 g/mol. IUPAC: (2S,3S)-1,2,4,4-tetramethyl-3-prop-1-en-2-yloxybicyclo[3.1.1]heptane.
Chemical Property Profile of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate
Property Insights of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate
The XLogP value of 3.9974 indicates that Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate?
The CAS number of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate is 102322-85-0.
What is the molecular formula of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate?
The molecular formula of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate is C14H24O.
What is the molecular weight of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate?
The molecular weight of Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate is 208.18 g/mol.
Where can I buy Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate?
You can request a quote for Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo(3.1.1)heptanol, 2,6,6-trimethyl-, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.